oxoalumane

H4Al4O4 — CID 174526989

IUPACoxoalumane
SMILESO=[AlH].O=[AlH].O=[AlH].O=[AlH]
InChIInChI=1S/4Al.4O.4H
InChIKeyYLXCUTZWNWBFJY-UHFFFAOYSA-N
MW175.96 g/mol
LogP-3.07
Rot. Bonds

About oxoalumane

oxoalumane (PubChem CID 174526989) has the molecular formula H4Al4O4 and a molecular weight of 175.96 g/mol. Its IUPAC name is oxoalumane.

Molecular Properties

Compound Nameoxoalumane
PubChem CID174526989
Molecular FormulaH4Al4O4
Molecular Weight175.96 g/mol
Exact Mass175.94
IUPAC Nameoxoalumane
SMILESO=[AlH].O=[AlH].O=[AlH].O=[AlH]
InChIInChI=1S/4Al.4O.4H
InChIKeyYLXCUTZWNWBFJY-UHFFFAOYSA-N
XLogP-3.07
TPSA68.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.96
LogP ≤ 5-3.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of oxoalumane?
The IUPAC name of oxoalumane (CID 174526989) is oxoalumane.
What is the SMILES notation for oxoalumane?
The canonical SMILES for oxoalumane is O=[AlH].O=[AlH].O=[AlH].O=[AlH].
What is the InChIKey of oxoalumane?
The InChIKey is YLXCUTZWNWBFJY-UHFFFAOYSA-N. The full InChI is InChI=1S/4Al.4O.4H.
What are the key properties of oxoalumane?
oxoalumane has a molecular weight of 175.96 g/mol, XLogP of -3.07, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxoalumane is sourced from PubChem (CID 174526989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).